tert-butyl 4-(5-methyl-1-phenyl-imidazol-2-yl)-4-piperazin-1-yl-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-(5-methyl-1-phenyl-imidazol-2-yl)-4-piperazin-1-yl-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-(5-methyl-1-phenyl-imidazol-2-yl)-4-piperazin-1-yl-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 4-(5-methyl-1-phenyl-2-imidazolyl)-2-[oxo(3-thiazolidinyl)methyl]-4-(1-piperazinyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(5-methyl-1-phenylimidazol-2-yl)-4-piperazin-1-yl-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-(5-methyl-1-phenyl-imidazol-2-yl)-4-piperazino-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C27H38N6O3S MolecularWeight: 526.69402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N1C2=CC=CC=C2)C3(CC(N(C3)C(=O)OC(C)(C)C)C(=O)N4CCSC4)N5CCNCC5

Isomeric SMILES

CC1=CN=C(N1C2=CC=CC=C2)C3(CC(N(C3)C(=O)OC(C)(C)C)C(=O)N4CCSC4)N5CCNCC5

InChI

InChI=1S/C27H38N6O3S/c1-20-17-29-24(33(20)21-8-6-5-7-9-21)27(31-12-10-28-11-13-31)16-22(23(34)30-14-15-37-19-30)32(18-27)25(35)36-26(2,3)4/h5-9,17,22,28H,10-16,18-19H2,1-4H3